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10-PHENYL-11,12-DIOXATRICYCLO-[7.2.1.0(1,6)]-DODECAN-8-ONE
SpectraBase Compound ID 3DmTyRq4H50
InChI InChI=1S/C16H18O3/c17-13-10-12-8-4-5-9-16(12)18-14(15(13)19-16)11-6-2-1-3-7-11/h1-3,6-7,12,14-15H,4-5,8-10H2/t12-,14+,15+,16-/m1/s1
InChIKey HRDIIWAHHIGZPJ-SYAUCNOPSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BqwAteYRsUf
Name 10-PHENYL-11,12-DIOXATRICYCLO-[7.2.1.0(1,6)]-DODECAN-8-ONE
Compound Number 16D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c17-13-10-12-8-4-5-9-16(12)18-14(15(13)19-16)11-6-2-1-3-7-11/h1-3,6-7,12,14-15H,4-5,8-10H2/t12-,14+,15+,16-/m1/s1
InChIKey HRDIIWAHHIGZPJ-SYAUCNOPSA-N
Literature Reference Author S.MUTHUSAMI,S.A.BABU,C.GUNANATHAN,B.GANGULY,E.SURESH,P.DASTI DAR
Literature Reference Citation J.ORG.CHEM.,67,8019(2002)
Literature Reference DOI 10.1021/jo0256134
Molecular Weight 258.317 g/mol
Solvent CDCl3
Source File Reference UWMS23810